N-[(3-tert-butyl-4-dodecoxy-phenyl)methyl]-N-[(1-ethylpyridin-1-ium-4-yl)methyl]-2-methoxy-benzamide

Systemtic Name: N-[(3-tert-butyl-4-dodecoxy-phenyl)methyl]-N-[(1-ethylpyridin-1-ium-4-yl)methyl]-2-methoxy-benzamide Openeye Name: N-[(3-tert-butyl-4-dodecoxy-phenyl)methyl]-N-[(1-ethylpyridin-1-ium-4-yl)methyl]-2-methoxy-benzamide CAS Name: N-[(3-tert-butyl-4-dodecoxyphenyl)methyl]-N-[(1-ethyl-4-pyridin-1-iumyl)methyl]-2-methoxybenzamide IUPAC Name: N-[(3-tert-butyl-4-dodecoxyphenyl)methyl]-N-[(1-ethylpyridin-1-ium-4-yl)methyl]-2-methoxybenzamide Traditional Name: N-(3-tert-butyl-4-lauryloxy-benzyl)-N-[(1-ethylpyridin-1-ium-4-yl)methyl]-2-methoxy-benzamide Formula: C39H57N2O3+ MolecularWeight: 601.88148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=CC=[N+](C=C2)CC)C(=O)C3=CC=CC=C3OC)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=CC=[N+](C=C2)CC)C(=O)C3=CC=CC=C3OC)C(C)(C)C

InChI

InChI=1S/C39H57N2O3/c1-7-9-10-11-12-13-14-15-16-19-28-44-37-23-22-33(29-35(37)39(3,4)5)31-41(30-32-24-26-40(8-2)27-25-32)38(42)34-20-17-18-21-36(34)43-6/h17-18,20-27,29H,7-16,19,28,30-31H2,1-6H3/q+1